Basic information
- Standard SMILES
O=C(O)C(Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)F- InChIKey
OKZBEJACBVMFCS-UHFFFAOYSA-N- Molecular formula
- C11H10F3NO5
- Average molar mass
- 293.2 g/mol
Names & identifiers
- Preferred name
- 3-(3,4-Dihydroxyphenyl)-2-[(2,2,2-trifluoroacetyl)amino]propanoic acid
- IUPAC
- 3-(3,4-dihydroxyphenyl)-2-[(2,2,2-trifluoroacetyl)amino]propanoic acid
Names & synonyms
NSC280646SCHEMBL2495080OKZBEJACBVMFCS-UHFFFAOYSA-N3-(3,4-dihydroxyphenyl)-2-[(2,2,2-trifluoroacetyl)amino]propanoic acidNSC-280646
Database identifiers
- PubChem CID
- 322576
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 374
Related reactions
1 records
Compound notes
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